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    CAS 5807-30-7
    Also known as: 5807-30-7, 2-(3,4-dichlorophenyl)acetic acid, (3,4-dichlorophenyl)acetic acid, Benzeneacetic acid, 3,4-dichloro-, 3,4-dichlorobenzene acetic acid, 2-(3,4-dichlorophenyl)ethanoic acid
    Molecular Formula
    C8H6Cl2O2
    Molecular Weight
    205.03  g/mol
    InChI Key
    ZOUPGSMSNQLUNW-UHFFFAOYSA-N
    FDA UNII
    713NZ1A32D
    1 2D Structure

    CAS 5807-30-7

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-(3,4-dichlorophenyl)acetic acid
    2.1.2 InChI
    InChI=1S/C8H6Cl2O2/c9-6-2-1-5(3-7(6)10)4-8(11)12/h1-3H,4H2,(H,11,12)
    2.1.3 InChI Key
    ZOUPGSMSNQLUNW-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=C(C=C1CC(=O)O)Cl)Cl
    2.2 Other Identifiers
    2.2.1 UNII
    713NZ1A32D
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 5807-30-7

    2. 2-(3,4-dichlorophenyl)acetic Acid

    3. (3,4-dichlorophenyl)acetic Acid

    4. Benzeneacetic Acid, 3,4-dichloro-

    5. 3,4-dichlorobenzene Acetic Acid

    6. 2-(3,4-dichlorophenyl)ethanoic Acid

    7. 3,4dichlorophenylaceticacid

    8. 3,4-dichlorophenyl Acetic Acid

    9. Chembl3116309

    10. 713nz1a32d

    11. (3,4-dichloro-phenyl)-acetic Acid

    12. Mfcd00004333

    13. Nsc-132186

    14. 3,4-dichlorophenylaceticacid

    15. Einecs 227-368-7

    16. Nsc 132186

    17. 3,4dichlorophenylacetic Acid

    18. Schembl283587

    19. Unii-713nz1a32d

    20. 3,4-dichlorobenzeneacetic Acid

    21. 3,4-dichlorophenyl-acetic Acid

    22. 3,4-dichloro Phenyl Acetic Acid

    23. Dtxsid70206794

    24. Zinc156509

    25. (3,4-dichloro-phenyl) Acetic Acid

    26. Benzeneacetic Acid,?3,4-dichloro-

    27. Str02969

    28. Bdbm50461996

    29. Nsc132186

    30. Stk428923

    31. 2-(3,4-dichlorophenyl) Acetic Acid

    32. 3,4-dichlorophenylacetic Acid, 98%

    33. Akos000112358

    34. Ac-2903

    35. Cs-w020073

    36. Ncgc00242250-01

    37. Sy003305

    38. Db-021870

    39. Acetic Acid, (3,4-dichlorophenyl)-

    40. Am20060373

    41. D1813

    42. Ft-0614257

    43. 807d307

    44. W-105414

    45. Q27449859

    46. 05r

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 205.03 g/mol
    Molecular Formula C8H6Cl2O2
    XLogP33.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass203.9744848 g/mol
    Monoisotopic Mass203.9744848 g/mol
    Topological Polar Surface Area37.3 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity172
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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                                            Ivabradine Hydrochloride
                                            Recordati, established in 1926, is an international pharmaceutical group, listed on the Italian Stock Exc...
                                            Recordati, established in 1926, is an international pharmaceutical group, listed on the Italian Stock Exchange (Reuters RECI.MI, Bloomberg REC IM, ISIN IT 0003828271), with a total staff of around 4,000, dedicated to the research, development, manufacturing and marketing of pharmaceuticals. Headquartered in Milan, Italy, Recordati has operations in the main European countries, in Russia, in other Central and Eastern European countries, in Turkey, in North Africa and in the United States of America.
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                                            Suraj Labs

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                                              (S)-1-(3, 4-Dimethoxybicyclo [4.2.0] Octa-1, 3, 5- Trie...

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                                              Ivabradine Hydrochloride
                                              Suraj Laboratories Private Limited, established in 2021, is a pharmaceutical firm providing Contract Rese...
                                              Suraj Laboratories Private Limited, established in 2021, is a pharmaceutical firm providing Contract Research and Manufacturing Services (CRAMS), Custom Synthesis, and cGMP scale manufacturing services necessary for the large-scale production of Active Pharmaceutical Ingredients (APIs), Saleable Intermediates for APIs, and Key Starting Materials (KSMs). It operates as a specialized pharmaceutical bulk drug manufacturing entity located in India.
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